5-(2-bromophenyl)-2-methylpyridine

C12H10BrN — CID 156556672

IUPAC5-(2-bromophenyl)-2-methylpyridine
SMILESCc1ccc(-c2ccccc2Br)cn1
InChIInChI=1S/C12H10BrN/c1-9-6-7-10(8-14-9)11-4-2-3-5-12(11)13/h2-8H,1H3
InChIKeyJTXDKQZXYJGOSA-UHFFFAOYSA-N
MW248.12 g/mol
LogP3.82
Rot. Bonds1

About 5-(2-bromophenyl)-2-methylpyridine

5-(2-bromophenyl)-2-methylpyridine (PubChem CID 156556672) has the molecular formula C12H10BrN and a molecular weight of 248.12 g/mol. Its IUPAC name is 5-(2-bromophenyl)-2-methylpyridine.

Molecular Properties

Compound Name5-(2-bromophenyl)-2-methylpyridine
PubChem CID156556672
Molecular FormulaC12H10BrN
Molecular Weight248.12 g/mol
Exact Mass247.00
IUPAC Name5-(2-bromophenyl)-2-methylpyridine
SMILESCc1ccc(-c2ccccc2Br)cn1
InChIInChI=1S/C12H10BrN/c1-9-6-7-10(8-14-9)11-4-2-3-5-12(11)13/h2-8H,1H3
InChIKeyJTXDKQZXYJGOSA-UHFFFAOYSA-N
XLogP3.82
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.12
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Brompheniramine
CID 6834
(+-)-Dimethindene
CID 21855
Pheniramine
CID 4761
Zimelidine
CID 5365247
Dexbrompheniramine
CID 16960
5-Ethyl-2-methylpyridine
CID 7728
Anabaseine
CID 18985
4-Phenylpyridine
CID 13651
2-(3-Phenylpropyl)Pyridine
CID 459494
3-Phenylpyridine
CID 13886
2-Isobutylpyridine
CID 61385
4,4'-Dimethyl-2,2'-bipyridine
CID 14338

Frequently Asked Questions

What is the IUPAC name of 5-(2-bromophenyl)-2-methylpyridine?
The IUPAC name of 5-(2-bromophenyl)-2-methylpyridine (CID 156556672) is 5-(2-bromophenyl)-2-methylpyridine.
What is the SMILES notation for 5-(2-bromophenyl)-2-methylpyridine?
The canonical SMILES for 5-(2-bromophenyl)-2-methylpyridine is Cc1ccc(-c2ccccc2Br)cn1.
What is the InChIKey of 5-(2-bromophenyl)-2-methylpyridine?
The InChIKey is JTXDKQZXYJGOSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrN/c1-9-6-7-10(8-14-9)11-4-2-3-5-12(11)13/h2-8H,1H3.
What are the key properties of 5-(2-bromophenyl)-2-methylpyridine?
5-(2-bromophenyl)-2-methylpyridine has a molecular weight of 248.12 g/mol, XLogP of 3.82, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-bromophenyl)-2-methylpyridine is sourced from PubChem (CID 156556672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).